SCHEMBL4890309

SCHEMBL4890309

O=C1C=CC=C(C2=CN(CCN3CCC(c4ccccc4C(=O)NCCN4CCCC4)CC3)C=CO2)C1

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
BCL3 P20749 2/20 0.35
STAT3 P40763 1/20 0.35
DRD3 P35462 1/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
UTS2R Q9UKP6 2/20 0.35
HDAC3 O15379 1/20 0.35
HDAC1 Q13547 1/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL4885280 0.99 STAT3 (0.37) BCL3STAT3DRD3MEN1KMT2A
SCHEMBL4440078 0.92 UTS2R (0.36) BCL3DRD3UTS2RHDAC3HDAC1
SCHEMBL4891155 0.91 UTS2R (0.36) BCL3DRD3MEN1KMT2AUTS2R
SCHEMBL4433580 0.91 HDAC3 (0.36) BCL3MEN1KMT2AUTS2RHDAC3
SCHEMBL4430408 0.91 UTS2R (0.37) BCL3DRD3UTS2RHDAC3HDAC1
SCHEMBL4432781 0.91 NPFFR1 (0.36) MEN1KMT2AUTS2R
SCHEMBL4438087 0.90 UTS2R (0.43) DRD3UTS2R
SCHEMBL15808512 0.89 EPHX2 (0.37)
SCHEMBL4890241 0.89 HPGD (0.37) DRD3KMT2AUTS2RHDAC3HDAC1
SCHEMBL4438280 0.89 UTS2R (0.42) UTS2R

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8759342-B2 Benzo[1,4]oxazin-3-one, benzo[1,4]thiazin-3-one and quinolin-2-one urotensin II receptor antagonists JANSSEN PHARMACEUTICA NV (BE) 2014-06-24 US claimed
US-20080039454-A1 Urotensin II receptor antagonists JANSSEN PHARMACEUTICA, N.V. (BE) 2008-02-14 US claimed
US-8759342-B2 Benzo[1,4]oxazin-3-one, benzo[1,4]thiazin-3-one and quinolin-2-one urotensin II receptor antagonists JANSSEN PHARMACEUTICA NV (BE) 2014-06-24 US disclosed
US-20080039454-A1 Urotensin II receptor antagonists JANSSEN PHARMACEUTICA, N.V. (BE) 2008-02-14 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080039454-A1 Urotensin II receptor antagonists UTS2R, PLAUR, NTSR2 BCL3 4860/4885STAT3 3477/4885DRD3 1857/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.